1-(4-fluorophenyl)-N-(4-methylsulfanyl-1-oxidanylidene-1-piperidin-1-yl-butan-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-(4-methylsulfanyl-1-oxidanylidene-1-piperidin-1-yl-butan-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-[3-methylsulfanyl-1-(piperidine-1-carbonyl)propyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[4-(methylthio)-1-oxo-1-(1-piperidinyl)butan-2-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-(4-methylsulfanyl-1-oxo-1-piperidin-1-ylbutan-2-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-keto-N-[3-(methylthio)-1-(piperidine-1-carbonyl)propyl]pyrrolidine-3-carboxamide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCCC1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

CSCCC(C(=O)N1CCCCC1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H28FN3O3S/c1-29-12-9-18(21(28)24-10-3-2-4-11-24)23-20(27)15-13-19(26)25(14-15)17-7-5-16(22)6-8-17/h5-8,15,18H,2-4,9-14H2,1H3,(H,23,27)